Summary

IMPPAT Phytochemical identifier: IMPHY015679

Phytochemical name: Eudesma-4(15),7-dien-1-b-ol

Synonymous chemical names:
eudesma- 4(15),7-dien-1β- ol, eudesma-4 (15),7dien-1β-ol, eudesma-4(15),7-dien-1 β-ol, eudesma-4(15),7-dien-1- β -ol, eudesma-4(15),7-dien-1-b-ol, eudesma-4(15),7-dien-1-β-ol, eudesma-4(15),7-dien-1b-ol, eudesma-4(15),7-dien-4β-ol, f eudesma-4(15),7-dien-1β-ol

External chemical identifiers:
CID:6429131

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Chemical structure information

SMILES:
C=C1CC[C@H]([C@]2(C1CC(=CC2)C(C)C)C)O

InChI:
InChI=1S/C15H24O/c1-10(2)12-7-8-15(4)13(9-12)11(3)5-6-14(15)16/h7,10,13-14,16H,3,5-6,8-9H2,1-2,4H3/t13?,14-,15-/m1/s1

InChIKey:
FGPDTARJOXRWJD-JVIGXAJISA-N

DeepSMILES:
C=CCC[C@H][C@]C6CC=CC6))CC)C)))))C))O

Functional groups:
C=C(C)C, CC=C(C)C, CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCCC2CC=CCC12

Scaffold Graph/Node level:
CC1CCCC2CCCCC12

Scaffold Graph level:
CC1CCCC2CCCCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Eudesmane sesquiterpenoids

NP-Likeness score: 3.321

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Chemical structure download