ID: 101053
SMILES:O1c2cc(CCCCC)cc(O)c2C=CC(C)(C)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.519
InChIKey:JKKYPTUBOZURDV-UHFFFAOYSA-N
ID: 101054
SMILES:c12cc(O)ccc1OC(C)(C)C1C2C=C(COC(C)=O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.655
InChIKey:VPSVNTHIDAELFV-UHFFFAOYSA-N
ID: 101055
SMILES:C1C=C(C)C(O)C2c3c(O)cc(CCCCC)cc3OC1(CO)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.248
InChIKey:GCRLIARIXVMFEK-UHFFFAOYSA-N
ID: 101056
SMILES:c1c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 101057
SMILES:C(CCC1(C)C=Cc2c(O)cc(CCC)cc2O1)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -18.68
InChIKey:RFSBDKOBPVLAOQ-UHFFFAOYSA-N
ID: 101058
SMILES:C1C(C)CCC2C1c1c(cc(C)c(CC(O)=O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.503
InChIKey:GAHKTTPVVRHSDY-UHFFFAOYSA-N
ID: 101059
SMILES:c1(CC2C(=O)NC(C)O2)cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.477
CB1 binding score: -16.502
InChIKey:DCOBOFLNSPKHGE-UHFFFAOYSA-N
ID: 101060
SMILES:C12(O)C=CC(C(OC)=O)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.847
InChIKey:DDCTXFVAJKHYRM-UHFFFAOYSA-N
ID: 101061
SMILES:C1CC(C)=CC(c2c(O)ccc(CCNC)c2)C1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 285.431
CB1 binding score: -18.957
InChIKey:ONZQZEOQIONJOK-UHFFFAOYSA-N
ID: 101062
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 101063
SMILES:C(CC)CCc1cc2c(c(O)c1)C1CC(O)(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 101064
SMILES:c12c(c(O)cc(CCCCC)c1)C(C)(CCC=C(C)C)Oc1c2c(C)c(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -12.847
InChIKey:BLMDYSZTBYPORW-UHFFFAOYSA-N
ID: 101065
SMILES:C1(O)(C)CCC(OC(=O)C)C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.861
InChIKey:IEEYSODBECABRX-UHFFFAOYSA-N
ID: 101066
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.334
InChIKey:JRPARYVCKDQCGY-UHFFFAOYSA-N
ID: 101067
SMILES:Oc1c(C(OC)=O)c(CCCCC)cc2c1-c1cc(C)ccc1OC2(CCCCCC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.735
InChIKey:RBAUESQETOFGQO-UHFFFAOYSA-N
ID: 101068
SMILES:c1c(C)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 101069
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 101070
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: 101071
SMILES:c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 101072
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 101073
SMILES:O=C(Oc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.206
InChIKey:OBJCGQZOVMKGPI-UHFFFAOYSA-N