(Q104201184)

English

14,15,32,32-Tetramethyl-23-methylidene-9-prop-1-en-2-yl-10,31-dioxa-17-azanonacyclo[24.4.2.02,15.05,14.06,11.016,30.018,29.021,28.024,27]dotriaconta-6,16(30),18(29),19,21(28)-pentaene-5,8-diol

group of stereoisomers with the chemical formula C₃₇H₄₅NO₄

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Statements

instance of

group of stereoisomers

0 references

subclass of

indole-diterpenoid alkaloid

1 reference

inferred from

indole-diterpenoid alkaloid

mass

567.33485892 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₄₅NO₄

0 references

canonical SMILES

OC1C=C2C(OC1C(=C)C)CCC3(C)C2(O)CCC4C5OC(C)(C)C6CC7C(=C)CC8=CC=C9NC(=C5C9=C8C76)C43C

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found in taxon

Penicillium

1 reference

stated in

Tremorgenic mycotoxins from Penicillium crustosum. Structure elucidation and absolute configuration of penitrems B–F

Penicillium crustosum

1 reference

stated in

Structure and biosynthesis of the penitrems A–F, six novel tremorgenic mycotoxins from Penicillium crustosum

Penicillium solitum

1 reference

stated in

Structure and biosynthesis of the penitrems A–F, six novel tremorgenic mycotoxins from Penicillium crustosum

Identifiers

InChI

InChI=1S/C37H45NO4/c1-17(2)31-25(39)16-22-26(41-31)11-12-35(6)36(7)21(10-13-37(22,35)40)32-30-29-24(38-33(30)36)9-8-19-14-18(3)20-15-23(28(20)27(19)29)34(4,5)42-32/h8-9,16,20-21,23,25-26,28,31-32,38-40H,1,3,10-15H2,2,4-7H3

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InChIKey

XOASTWITKYDKAJ-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

XOASTWITKYDKAJ-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0256240

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

XOASTWITKYDKAJ-UHFFFAOYSA-N

(Q104201184)

14,15,32,32-Tetramethyl-23-methylidene-9-prop-1-en-2-yl-10,31-dioxa-17-azanonacyclo[24.4.2.02,15.05,14.06,11.016,30.018,29.021,28.024,27]dotriaconta-6,16(30),18(29),19,21(28)-pentaene-5,8-diol

Statements

Identifiers

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