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(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione

(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione ??? ???
?? ??:
511-07-9
???:
(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
???(??):
8a-isomer;Ergocristinine;Isoergocristine;Einecs 208-119-1;(8α)-12'-Hydroxy-2'-isopropyl-5'α-(phenylmethyl)ergotaman-3',6',18-trione;(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione;Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (5'α,8α)-;(5'alpha,8alpha)-12'-Hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)ergotaman-3',6',18-trione;Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (5'alpha,8alpha)-
CBNumber:
CB1930991
???:
C35H39N5O5
??? ??:
609.71
MOL ??:
511-07-9.mol

(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione ??

???
226℃ (decomposition) (ethanol )
??
D20 +366° (c = 0.68 in chloroform); +471° (c = 0.35 in pyridine)
?? ?
655.69°C (rough estimate)
??
1.1839 (rough estimate)
???
1.7210 (estimate)
?? ?? (pKa)
9.59±0.60(Predicted)
??
  • ?? ? ?? ??
  • ?? ? ???? ?? (GHS)
????(UN No.) 1544
?? ?? 6.1(b)
???? III
????(GHS): GHS hazard pictograms
?? ?: Danger
??·?? ??:
?? ??·?? ?? ?? ?? ?? ?? ? ?? ?? P- ??
H301 ??? ??? ?? ?? ?? - ?? ?? 3 ?? GHS hazard pictograms P264, P270, P301+P310, P321, P330,P405, P501
H311 ??? ???? ??? ?? ?? ?? - ?? ?? 3 ?? GHS hazard pictograms P280, P302+P352, P312, P322, P361,P363, P405, P501
H331 ???? ??? ?? ?? ?? ?? ?? 3 ?? GHS hazard pictograms P261, P271, P304+P340, P311, P321,P403+P233, P405, P501
??????:
P261 ??·?·??·???·??·...·????? ??? ????.
P264 ?? ??? ?? ??? ????.
P264 ?? ??? ?? ??? ????.
P270 ? ??? ??? ??? ???, ???? ???? ???.
P271 ?? ?? ??? ? ?? ???? ?????.
P280 ????/???/???/?????? ?????.
P301+P310 ???? ?? ????(??)? ??? ????.
P302+P352 ??? ??? ??? ?? ????.
P304+P340 ???? ??? ??? ?? ??? ??? ???? ?? ??? ??? ????.
P311 ????(??)? ??? ????.
P312 ???? ??? ????(??)? ??? ????.
P321 (…) ??? ???.
P322 ?? ??(??? … ??)
P330 ?? ?????.
P361 ?? ??? ??? ?? ?? ?
P363 ?? ??? ??? ??? ?????.
P403+P233 ??? ??? ? ?? ?? ??? ???? ?????.
P405 ???? ?????.
P501 ...? ??? / ??? ?? ???.

(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione C??? ??, ??, ??

??

Isoergocristine is an ergot fungus alkaloid related to Ergocristine (E597450). It is a mycotoxin found in moldy food products.

(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione ?? ?? ? ???

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(8alpha)-5'alpha-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione ?? ??

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