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Molecule Identifiers
Molecular Properties

ID: 4012

SMILES:
Oc1c(C(=O)C(CC)C)c(O)c(C=O)c2c1C1C=C(C)CCC1C(C)(C)O2

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids;Phloroglucinols

Class: Cannabinoids;Phloroglucinol-terpene hybrids

MW: 372.461

InChIKey:
PCQGORPGJVHXJE-UHFFFAOYSA-N

ID: 4013

SMILES:
C1(c2c(CCCCC)cc(O)c(C3C(C(C)=C)CCC(C)=C3)c2O)OC(C)(C)C=CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 424.625

InChIKey:
GUEMDWLPHHLKFN-UHFFFAOYSA-N

ID: 4014

SMILES:
O(c1ccc(C2C(C(C)=C)C(c3cc(CCC(=O)C)cc4c3OC(C)(C)C(OC(=O)OC)C4)C=C(CO)C2)cc1)C

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 562.703

InChIKey:
BWRPKRWDKABDSS-UHFFFAOYSA-N

ID: 4015

SMILES:
C1C(C(=C)C)C(c2cc(O)cc(CCC=C)c2)C=C(C)C1O

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 298.426

InChIKey:
FOBPYHPCHDMVDB-UHFFFAOYSA-N

ID: 4016

SMILES:
C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 300.442

InChIKey:
RVWTXSLOGRTPEH-UHFFFAOYSA-N

ID: 4017

SMILES:
C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21)C1C(C)(C)C2C(CC)=CC(C)(C)C1(CC=C(C)C)C2

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 586.945

InChIKey:
ZXAJGDNGGHDPOP-UHFFFAOYSA-N

ID: 4018

SMILES:
C(C=C(C)C)CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)c(O)c1O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 376.493

InChIKey:
BZHWTNCHQIQETM-UHFFFAOYSA-N

ID: 4019

SMILES:
CC1=CC(c2ccc(CCC(C)C)cc2)C(C(=C)C)CC1

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 282.471

InChIKey:
APZCRHZCJUBAHD-UHFFFAOYSA-N

ID: 4020

SMILES:
C12(CC(C)=O)c3c(cc(CCCCC)cc3O)OC(C)(CC1)CCC2C(C)C

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 386.576

InChIKey:
RSROWCYPHHNPAP-UHFFFAOYSA-N

ID: 4021

SMILES:
C(CCCCCC)c1cc(O)c2c(c1O)C1=C(C(C)(C)O2)CCC(C)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 358.522

InChIKey:
JSZHKHOWNVMEIL-UHFFFAOYSA-N

ID: 4022

SMILES:
C1CC2(C)c3c(c(OC)c(OC)cc3)C=C2C2=C1c1c(cc(OCC=C(C)CCC=C(C)C)cc1)OC2(C)C

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 526.717

InChIKey:
USJQNCPWUGZWJB-UHFFFAOYSA-N

ID: 4023

SMILES:
CC(C)(CC1c2ccc(C)cc2OC1(C)C)OC

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 248.366

InChIKey:
YQMPYBNZKUXMFP-UHFFFAOYSA-N

ID: 4024

SMILES:
CC1(C)Oc2c(c3c(c(C(CC)C)c2)OC2(C)C4C(OC(=O)C)CC(C)CC4C=C23)C(c2ccccc2)C1C(C)=O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 556.743

InChIKey:
MNPVYOFECLFPNE-UHFFFAOYSA-N

ID: 4025

SMILES:
O=C(C1(C)C2C(c3c(cc(CCCCC)cc3O)O1)CC(C)C2)OC

Pathway: Polyketides

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 346.467

InChIKey:
UTSOKQFJHGRVAF-UHFFFAOYSA-N

ID: 4026

SMILES:
C1(Cc2c(O)cc(CCCCCO)cc2O)(C)C(C)C(=O)CC2(C)C1CCC=C2C

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 414.586

InChIKey:
BKPPUDGTSWBIIO-UHFFFAOYSA-N

ID: 4027

SMILES:
CC1(C)C2CCC(C)=CC3C1c1c(O)cc(CCCCC)cc1OC23

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 340.507

InChIKey:
JTZQILWPTMXWKX-UHFFFAOYSA-N

ID: 4028

SMILES:
CC(CCC)=CCCc1cc2c(c(O)c1)C=CC(C)(CCC=C(C)C)O2

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 354.534

InChIKey:
OXWHSMXACXZKAZ-UHFFFAOYSA-N

ID: 4029

SMILES:
c12c(O)c(O)c(CCCCC)cc1OC(C)(C)C1C(C2)c2c(c(O)cc(C)c2O)C1=O

Pathway: Polyketides

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 426.509

InChIKey:
NSYVMJVWPYKOIB-UHFFFAOYSA-N

ID: 4030

SMILES:
c1(CCCCC)cc2c(cc1O)OC(C)(C)C1C2C=C(C(=O)O)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 344.451

InChIKey:
NGFPAXCHIPIMOG-UHFFFAOYSA-N

ID: 4031

SMILES:
c1(C(O)(CC(CCCCCCCC)O)C)c(O)c2c(c(C=O)c1OC)OC(C)(C)C1C2C=C(C)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 502.692

InChIKey:
ZCVMZVOFIMIOPE-UHFFFAOYSA-N

ID: 4032

SMILES:
Oc1c(CC=C(CCC=C(C)C)C)cc(O)cc1CCCCC

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 316.485

InChIKey:
XKWLUCZAWFMDAL-UHFFFAOYSA-N

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