(Q105292179)

English

(3S,4S,5S,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4,10,13-trimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

17-(5,6-dimethylhept-3-en-2-yl)-4,10,13-trimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

412.370516156 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₈O

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canonical SMILES

OC1CCC2(C3=C(CCC2C1C)C4CCC(C(C=CC(C)C(C)C)C)C4(C)CC3)C

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isomeric SMILES

CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)[C@@H](C)[C@@H]1CC3

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found in taxon

Scrippsiella trochoidea

1 reference

stated in

Lipid composition of the marine dinoflagellate Scrippsiella trochoidea

Scrippsiella acuminata

1 reference

stated in

Lipid composition of the marine dinoflagellate Scrippsiella trochoidea

Identifiers

InChI

InChI=1S/C29H48O/c1-18(2)19(3)8-9-20(4)23-12-13-25-22-10-11-24-21(5)27(30)15-17-29(24,7)26(22)14-16-28(23,25)6/h8-9,18-21,23-25,27,30H,10-17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24-,25-,27-,28+,29-/m0/s1

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InChIKey

VSGFTONSNLGNKU-SQNSDPAQSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105292179)

(3S,4S,5S,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4,10,13-trimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Statements

Identifiers

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