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Molecule Identifiers
Molecular Properties

ID: 3067

SMILES:
c1(O)c(CC=C(CCC=C(C)C)C)ccc(CCCCC)c1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids;Aromatic polyketides

Class: Cannabinoids;Catechols with side chains

MW: 300.486

InChIKey:
KXYIDYXHLDYCQN-UHFFFAOYSA-N

ID: 3068

SMILES:
Cc1cc2c(c(OC)c1)C1=C(C(C)(C)O2)CCC(C)C1

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 272.388

InChIKey:
GZQJHIWXZCYIDJ-UHFFFAOYSA-N

ID: 3069

SMILES:
c12c(cc(CCCCC)cc1)OC(C)(C)C1C2CC(C)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 300.486

InChIKey:
BYIOERCQWYRJAJ-UHFFFAOYSA-N

ID: 3070

SMILES:
C1C(O)C(O)C(Oc2c(O)cc3c(c2CCCC)OC(C)(C)C2CC=C(C)CC32)O1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 418.53

InChIKey:
QHCGXWJWBGUZFH-UHFFFAOYSA-N

ID: 3071

SMILES:
c1(O)c(C(C(=O)C)C)cc2c(c1)C1C(C(C)(C)O2)CC(C)(O)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids;Sesquiterpenoids

Class: Bisabolane sesquiterpenoids;Cannabinoids

MW: 332.44

InChIKey:
CWPYTVPEWBYVEX-UHFFFAOYSA-N

ID: 3072

SMILES:
C(C(Cl)(Cl)Cl)(=Cc1cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1)C

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 385.762

InChIKey:
XTWUFYKBFSTIML-UHFFFAOYSA-N

ID: 3073

SMILES:
c1(O)cc(CCc2ccc(O)c(OC)c2)cc2c1C1=C(C(C)(C)O2)CCC(C)C1

Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 394.511

InChIKey:
HUZUTPCCGSZZHA-UHFFFAOYSA-N

ID: 3074

SMILES:
Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 258.361

InChIKey:
MMZAEMNNHWYQKW-UHFFFAOYSA-N

ID: 3075

SMILES:
C1(C)(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C(=O)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 330.468

InChIKey:
AAZSXXIEAYXFSH-UHFFFAOYSA-N

ID: 3076

SMILES:
C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 314.469

InChIKey:
CYQFCXCEBYINGO-UHFFFAOYSA-N

ID: 3077

SMILES:
C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 284.487

InChIKey:
KCGRQTUOQYSEJY-UHFFFAOYSA-N

ID: 3078

SMILES:
C12(O)C(CC(O)C1(C)C)c1c(O)cc(C)cc1OC2(C)C

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 292.375

InChIKey:
MOHMTNVGJRIWBG-UHFFFAOYSA-N

ID: 3079

SMILES:
C12C(=Cc3c(O)c(C(O)=O)c(CCCCC)cc3O1)C1C(C(C)(O)CC2)OC(C)(C)C1CC=C(C)C

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 498.66

InChIKey:
OAGYWFTYDWOWKI-UHFFFAOYSA-N

ID: 3080

SMILES:
O=C1C2(C)Oc3c(c(O)cc(CCCCC)c3)C3(C2)C(C)CCC13C(C)C

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 370.533

InChIKey:
BUCLAEJTXCREJL-UHFFFAOYSA-N

ID: 3081

SMILES:
c1(O)c2c(cc(C(=O)C(C)C)c1O)OC(C)(C)C1C2CC(C)=CC1O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 346.423

InChIKey:
QBHYAXREJMXSPU-UHFFFAOYSA-N

ID: 3082

SMILES:
c12c(c(CC=C(C)CCC=C(C)C)cc(C)c1O)OC(C)(C)C1C2C=C(C)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 394.599

InChIKey:
LSNYTXDBYHCGKQ-UHFFFAOYSA-N

ID: 3083

SMILES:
C12(C)Oc3c(c(O)cc(CCCCC)c3)C(C1)C(C)(O)CCC(C(C)=C)C2

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 372.549

InChIKey:
QQPGZMXYMXNICF-UHFFFAOYSA-N

ID: 3084

SMILES:
O=C(O)c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 358.478

InChIKey:
UCONUSSAWGCZMV-UHFFFAOYSA-N

ID: 3085

SMILES:
c1(O)c(C(CC)C(C)OC(C)=O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 388.504

InChIKey:
AONSSBKINASVNM-UHFFFAOYSA-N

ID: 3086

SMILES:
CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C)CC2

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 314.469

InChIKey:
CYQFCXCEBYINGO-UHFFFAOYSA-N

ID: 3087

SMILES:
C1C2C(C)(C)Oc3cc(CCCC)c(C(OC(C)C)=O)c(O)c3C2C=C(C)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 386.532

InChIKey:
UEGYWGNZULHNJT-UHFFFAOYSA-N

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