ID: 60880
SMILES:C12C(C)(CC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O)C(=C)C1C2CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -13.828
InChIKey:XSNQYGZESGUZDJ-UHFFFAOYSA-N
ID: 60881
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 60882
SMILES:C1(C)(C)C2CC(O)C(C)=CC1c1c(cc(CCCCC)c(C(=O)O)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.882
InChIKey:ZNSAFBKASASLIT-UHFFFAOYSA-N
ID: 60883
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(CCc2ccc(O)c(C)c2)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -13.031
InChIKey:LDVHXMYWMBRKCK-UHFFFAOYSA-N
ID: 60884
SMILES:CC(=CCCC(CCCC(C)=CCc1cc(O)cc(C)c1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.162
InChIKey:GVVUQQWWMGBFAL-UHFFFAOYSA-N
ID: 60885
SMILES:c1(CCCCC)c(O)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.178
InChIKey:QGOQBAPWMFNGTE-UHFFFAOYSA-N
ID: 60886
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.602
InChIKey:FZYASIYATWAKPB-UHFFFAOYSA-N
ID: 60887
SMILES:c1(O)cc2c(cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 60888
SMILES:CCCCCc1c(-c2c(C(CC)=O)c(O)c(C3C=C(C(=O)O)CCC3C(=C)C)c(O)c2)cccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -14.239
InChIKey:RFNGYCZSSIMLPZ-UHFFFAOYSA-N
ID: 60889
SMILES:c12c(O)cc(CCCCC)c(C(=O)O)c1OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.955
InChIKey:XPMKPNGAEAMVRF-UHFFFAOYSA-N
ID: 60890
SMILES:C(=CCCC1(C)C=Cc2c(c(C)cc(O)c2)O1)(C)CCC1C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.553
InChIKey:ACVWHKVJGOVUKG-UHFFFAOYSA-N
ID: 60891
SMILES:C(O)C1C(OC2C(O)C(O)C(O)C(CO)O2)OCC2C(=O)OCC3CC=C(C)COC23c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 624.68
CB1 binding score: -14.326
InChIKey:XPBIGTIGHYPKPG-UHFFFAOYSA-N
ID: 60892
SMILES:CC1=CC2c3c(cc(CCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.936
InChIKey:TZFPIQSSTVIJTQ-UHFFFAOYSA-N
ID: 60893
SMILES:C(CCC)Cc1c(OC(C)=O)c2c3c(c1O)OC1(C)CCC2C(C)(C)C1C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: Not available
InChIKey:JKUKZCLDAGYBCK-UHFFFAOYSA-N
ID: 60894
SMILES:CC(C)CC(OC1CCC2C(C)(Cc3c(O)c(C(O)=O)c(CCCCC)cc3O)OC2C1C(C)=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.648
CB1 binding score: -15.519
InChIKey:PDHAXIVEYFDXOH-UHFFFAOYSA-N
ID: 60895
SMILES:CC(C(OC(=O)C(CC)C)CCc1cc2c(c(O)c1)C1=C(C(C)(C)CCC1)CCC(C)(CCO)O2)C(CC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.801
CB1 binding score: -14.129
InChIKey:ILNUIXYVUHEXKD-UHFFFAOYSA-N
ID: 60896
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60897
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.369
InChIKey:YUWDHDPGZUPROY-UHFFFAOYSA-N
ID: 60898
SMILES:CC1(c2c(O)cc(CCCCC)cc2)CCC(C)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -16.502
InChIKey:PHNLYUHACAHXIF-UHFFFAOYSA-N
ID: 60899
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 60900
SMILES:C1(C(C)C)CCC(C)(O)C2Oc3c(c(O)cc(CCC)c3)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.729
InChIKey:QAMUCWBQNARAQQ-UHFFFAOYSA-N