ID: 34987
SMILES:CC1=CC2=C(CC1)C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 270.372
CB1 binding score: -15.176
InChIKey:KTZJYAALULPAPR-UHFFFAOYSA-N
ID: 34988
SMILES:c1(CC=C(CCC=C(C)C)CO)cc(CC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.779
InChIKey:WTSAQPPLISAZJG-UHFFFAOYSA-N
ID: 34989
SMILES:C(C(C)C)(OC(=O)c1c2c(ccc1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.855
InChIKey:TZWHDJZJIRDDPS-UHFFFAOYSA-N
ID: 34990
SMILES:C12c3c(cc(CCCCC)cc3O)OC3(C)CCC1C(O)(C)CCC(C(C)=C2)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.764
InChIKey:QNVGVZBLACNVRP-UHFFFAOYSA-N
ID: 34991
SMILES:C(C(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 34992
SMILES:C1CC(C)=CC(c2c(CCCCC)cc(O)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.609
InChIKey:NTTXKNGMNAMJDR-UHFFFAOYSA-N
ID: 34993
SMILES:C12c3c(O)cc(C)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 34994
SMILES:C(CCCC)c1cc(O)c2c(c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.219
InChIKey:VLTJKSJCCUFHBB-UHFFFAOYSA-N
ID: 34995
SMILES:CC(=C)CC(Oc1ccc(C2C(C(C)=C)CCC(CO)=C2)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.092
InChIKey:QNDHLUAIGILZGY-UHFFFAOYSA-N
ID: 34996
SMILES:C1CCC(C)(C)C(c2c(O)cc(CCCCC)c(C(=O)O)c2)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.586
InChIKey:KJBQIKKRNIRYHC-UHFFFAOYSA-N
ID: 34997
SMILES:c1(CCCC)c(O)c2c3c(c1)OC(C)(C)C1C3CC(C)C=C1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.454
InChIKey:HOKZCAATRRSWSB-UHFFFAOYSA-N
ID: 34998
SMILES:C1C(C)(O)CC(c2c(O)cc(CCCC)cc2)OC1C(C)(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -13.194
InChIKey:CHVAHGXKTMKFSP-UHFFFAOYSA-N
ID: 34999
SMILES:C(=CC(O)(C)CCC(O)C(=C)C)C(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.431
InChIKey:VJTDFLKKRKWLIB-UHFFFAOYSA-N
ID: 35000
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(C)CCC2C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.334
InChIKey:LTJOTHGPJVLRQN-UHFFFAOYSA-N
ID: 35001
SMILES:O=C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2OC(C(C)C)(CC=C1C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.292
InChIKey:NNPYXPIOQLOOTB-UHFFFAOYSA-N
ID: 35002
SMILES:C(=C(C)C)CCC(=C)c1c(O)cc(C)c(O)c1Oc1c(O)c2c(c(C=O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.649
CB1 binding score: -18.513
InChIKey:SZRVVKVACXYZJQ-UHFFFAOYSA-N
ID: 35003
SMILES:c1(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 35004
SMILES:O(c1c2c(cc(CCCC)c1)OC(C)(C)C1C2CC(C)CC1)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:QRQKNWZWTJONRL-UHFFFAOYSA-N
ID: 35005
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)cc(OC)cc1C)=CC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -16.558
InChIKey:DJIMONACIARBBM-UHFFFAOYSA-N
ID: 35006
SMILES:CC1(C)Oc2cc(C)c(CC(=O)OC)c(O)c2C2C3OC3C(C(OC)=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.405
CB1 binding score: -15.699
InChIKey:NRCPNYGAXFPLKO-UHFFFAOYSA-N
ID: 35007
SMILES:C(C)CC1(c2c(O)cc(CCCCCO)cc2O)C=C2OC(CCC1C(C)=C)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.415
InChIKey:VSUIKNUJCVKNDZ-UHFFFAOYSA-N