ID: 63400
SMILES:COc1cc(C)c2c(c1)CC13C(=C(C)CCC1C(C)(C)O2)C(=O)C(=O)C3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -12.26
InChIKey:ZJARLTBNGSCTTP-UHFFFAOYSA-N
ID: 63401
SMILES:c1(CCOC2C(O)C(O)C(O)C(CO)O2)cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.528
CB1 binding score: -15.577
InChIKey:HFGCDBKEUVIDEA-UHFFFAOYSA-N
ID: 63402
SMILES:C12C(c3c(OC(=O)CCCCCCC)cc(CCCCC)cc3O1)CC(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.282
InChIKey:NAQDOYDOQOOKFP-UHFFFAOYSA-N
ID: 63403
SMILES:C12N(CCC(O)=O)C=CC(=O)C3=C(C1(C)CCCC2(C)C)C1CCC(Oc2cc(CCCCC)cc(O)c21)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 579.778
CB1 binding score: -14.369
InChIKey:IXLYCJRJMHWODV-UHFFFAOYSA-N
ID: 63404
SMILES:O(C(=O)CCCCCCCCC(CCCC)COCc1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.801
CB1 binding score: -16.541
InChIKey:HOCRKHCBTLUADR-UHFFFAOYSA-N
ID: 63405
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1CC(C(C)C)C=CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.147
InChIKey:RJJJMDXJZDTRKV-UHFFFAOYSA-N
ID: 63406
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(CO)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 63407
SMILES:CC(=O)CCC1C(C)(C)Oc2cc(CCCCC)c(C(=O)OC)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.189
InChIKey:OIYUPJOVEFQWCJ-UHFFFAOYSA-N
ID: 63408
SMILES:C1=C(C)CCC(C(C)C)C1c1c(OC)c(CCCCC)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.559
InChIKey:YEJMAGLZLIQUEK-UHFFFAOYSA-N
ID: 63409
SMILES:c1c(OC)ccc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.781
InChIKey:BNQJIOBVNUXALY-UHFFFAOYSA-N
ID: 63410
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 63411
SMILES:COC(CC(=CCc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.838
InChIKey:YTQYJDQWCFPNAS-UHFFFAOYSA-N
ID: 63412
SMILES:C(CCC)Cc1cc2c(c(O)c1C=O)CC1C(C)(O2)C=CC(C(O)(C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.003
InChIKey:OVKLKFSUCKSYJT-UHFFFAOYSA-N
ID: 63413
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 63414
SMILES:c1c(CCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 63415
SMILES:C(CCC)Cc1cc2c(cc1O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.497
InChIKey:MPSLHJUTUUBRHL-UHFFFAOYSA-N
ID: 63416
SMILES:C(CCC)Cc1cc2c(cc1O)CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -14.907
InChIKey:QOXBRBMIVHXJNV-UHFFFAOYSA-N
ID: 63417
SMILES:CCCCCc1cc2c(c(O)c1C=O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.059
InChIKey:IVRCBDVTRVUPTL-UHFFFAOYSA-N
ID: 63418
SMILES:C(c1c(O)c2c(c(CO)c1)OC(C)(C)C1CCC(C)=CC21)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -12.88
InChIKey:NIQISKJWKMAOGA-UHFFFAOYSA-N
ID: 63419
SMILES:C(CC(=CCCC1(C)C=Cc2cc(O)cc1c2)C)c1c(CC=C(C)C)c(O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.799
CB1 binding score: -15.719
InChIKey:DZNDCWWKVSPGQA-UHFFFAOYSA-N
ID: 63420
SMILES:O1C2(C)CC(OC(=O)c3ccc(OC)cc3)C3C(C(C)(C)Oc4c3c(O)cc(CCCCC)c4)CC3C1CCC2(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.746
CB1 binding score: -16.813
InChIKey:SJRBEVOJNWLRDK-UHFFFAOYSA-N