ID: 113758
SMILES:C(C1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1O)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.086
InChIKey:WYYCABBPIBVALU-UHFFFAOYSA-N
ID: 113759
SMILES:C12CC=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 113760
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 113761
SMILES:C(C(Oc1cc2c(c(C)c1)OC(CCC=C(C)C)(C)C=C2)=O)CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.544
InChIKey:QHMATIBWTOSYDH-UHFFFAOYSA-N
ID: 113762
SMILES:C1(OC(=O)C)C2C(C(C)(C)Oc3cc(CCCCC)cc(OC)c31)CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -13.859
InChIKey:AOTKDDFUYBJAQV-UHFFFAOYSA-N
ID: 113763
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 113764
SMILES:CC(C)(C1C(c2cc(CCCCC)cc(O)c2)C=C(C)CC1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.957
InChIKey:ZWKXGAZFTWCMFB-UHFFFAOYSA-N
ID: 113765
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(CC1=O)C(C)CCC2C(C=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -9.502
InChIKey:MKMWTHCJRQLJAY-UHFFFAOYSA-N
ID: 113766
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 113767
SMILES:C(=O)(C)Oc1c(CCCCC)cc2c(c1O)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.399
InChIKey:YLUKPZLMXIPVPU-UHFFFAOYSA-N
ID: 113768
SMILES:c1c(O)c2c(cc1O)C13COC(CCCCCCCCCCC)(C)C4C1(CC(C)(C)C4)C=C(C)C2C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.76
CB1 binding score: -15.562
InChIKey:HSFJGPWDZONOBB-UHFFFAOYSA-N
ID: 113769
SMILES:C1=CC(C)(C)Oc2c(cc(C(OC)=O)c(C)c2)C(O)C1(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.953
InChIKey:ULEIHJQFPMQABD-UHFFFAOYSA-N
ID: 113770
SMILES:C(C=C(C)C)c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 113771
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.882
InChIKey:UEFGHYCIOXYTOG-UHFFFAOYSA-N
ID: 113772
SMILES:O(C)c1c(CC=C(C)C=CC2(C(C)=C)CCCC2C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.917
InChIKey:IXJOOCKVUXSXAS-UHFFFAOYSA-N
ID: 113773
SMILES:C12C3(C)CC(=O)OC(C)(C)C3C(O)C(=O)C1(C)Oc1c2cc(OC)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -16.208
InChIKey:VXUQOTVJEAJDCP-UHFFFAOYSA-N
ID: 113774
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(CO)CC(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.324
InChIKey:NRUNPFJCAWCDJM-UHFFFAOYSA-N
ID: 113775
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 113776
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 113777
SMILES:C(C)(=CCCC(C1Cc2c(O)cc(CCCCC)cc2O1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.061
InChIKey:KUJCTBMVKRWDKP-UHFFFAOYSA-N
ID: 113778
SMILES:C(C1(C)C(=O)CC(c2cc(C)c(CCCCC)cc2O)O1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.443
InChIKey:WQSSYOPRTYPGOS-UHFFFAOYSA-N