Summary

IMPPAT Phytochemical identifier: IMPHY017824

Phytochemical name: Opposita-4(15),7(11)-dien-1beta-ol

Synonymous chemical names:
opposita-4(15),7(11)-dien-1β-ol, oppositα-4(15),7(11)-dien-1β-ol

External chemical identifiers:
CID:91747178

---

Chemical structure information

SMILES:
CC(=C[C@@H]1CC[C@]2(C1C(=C)CC[C@@H]2O)C)C

InChI:
InChI=1S/C15H24O/c1-10(2)9-12-7-8-15(4)13(16)6-5-11(3)14(12)15/h9,12-14,16H,3,5-8H2,1-2,4H3/t12-,13-,14?,15+/m0/s1

InChIKey:
CZFKRGCIADMIRY-ZAQQFOKRSA-N

DeepSMILES:
CC=C[C@@H]CC[C@]C5C=C)CC[C@@H]6O))))))C))))))C

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

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCCC2CCCC12

Scaffold Graph/Node level:
CC1CCCC2CCCC12

Scaffold Graph level:
CC1CCCC2CCCC12

---

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: Oppositane sesquiterpenoids

NP-Likeness score: 3.118

---

Chemical structure download