(Q104922279)

English

Nervisterol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

10,13-dimethyl-17-(6-methyl-5-propan-2-ylhepta-3,6-dien-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from SMILES

24-isopropenyl-22E-dehydrocholesterol

1 reference

based on heuristic

inferred from SMILES

mass

424.370516156 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2S,3E,5S)-6-methyl-5-propan-2-ylhepta-3,6-dien-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,8S,9S,10R,13R,14S,17S)-10,13-dimethyl-17-[(2R,3E,5S)-6-methyl-5-propan-2-ylhepta-3,6-dien-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₈O

0 references

canonical SMILES

OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C=CC(C(=C)C)C(C)C)C)C2(C)CC1

0 references

isomeric SMILES

C=C(C)[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C

0 references

found in taxon

Ervilia purpurea

1 reference

stated in

Studies on the constituents of orchidaceous plants. III. Isolation of non-conventional side chain sterols from Nervilia purpurea SCHLECHTER and structure determination of nervisterol.

Nervilia plicata

1 reference

stated in

Studies on the constituents of orchidaceous plants. III. Isolation of non-conventional side chain sterols from Nervilia purpurea SCHLECHTER and structure determination of nervisterol.

Topsentia ophiraphidites

1 reference

stated in

Ophirasterol, a new C31 sterol from the marine sponge Topsentia ophiraphidites.

Identifiers

InChI

InChI=1S/C30H48O/c1-19(2)24(20(3)4)10-8-21(5)26-12-13-27-25-11-9-22-18-23(31)14-16-29(22,6)28(25)15-17-30(26,27)7/h8-10,20-21,23-28,31H,1,11-18H2,2-7H3/b10-8+/t21-,23+,24+,25+,26-,27+,28+,29+,30-/m1/s1

0 references

InChIKey

BALNAVKTUKBYSD-KTTBASJBSA-N

0 references

CAS Registry Number

81262-96-6

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

inferred from InChIKey

1 reference

1 reference

matched by identifier from

InChIKey

BALNAVKTUKBYSD-KTTBASJBSA-N

(Q104922279)

Nervisterol

Statements

Identifiers

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