ID: 126022
SMILES:C1(OC(=O)C)(C)CCC2C(C)(C)Oc3c(CCCCC)cc(O)c(C(O)(CC(O)C(=O)C)C)c3C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.647
CB1 binding score: -15.249
InChIKey:WVXNYRNQUIOPBO-UHFFFAOYSA-N
ID: 126023
SMILES:C(O)(CC=C(C)C)C(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.172
InChIKey:LORJZFSTSFQWBQ-UHFFFAOYSA-N
ID: 126024
SMILES:C1(C)=CC(c2c(O)c3oc(CCC)cc3cc2OC)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.823
InChIKey:JMOBGVNPQWJGKC-UHFFFAOYSA-N
ID: 126025
SMILES:C12C(C)(C)C34C(C3(C)C1Oc1cc(CCCCC)oc1O2)CC(C)=CC4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.022
InChIKey:XLHAFLJCKSAMEZ-UHFFFAOYSA-N
ID: 126026
SMILES:c12c(ccc(CCCC)c1)C1=C(C(C)(C)O2)CCC(CCC=C(C)C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.365
InChIKey:IYEOTLIWJPZOMB-UHFFFAOYSA-N
ID: 126027
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 126028
SMILES:c1(OC(=O)C)cc(CCCCC)cc(O)c1C1C=[N+](O)OC(C)(C)C1C(=O)C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.526
CB1 binding score: -15.156
InChIKey:NEJJGSWDPCYGAI-UHFFFAOYSA-O
ID: 126029
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 126030
SMILES:CC1(O)C=C2C(C)(C)CC1c1c(O)cc(CCCCC)cc1OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.643
InChIKey:IZGYNRDCHSZABK-UHFFFAOYSA-N
ID: 126031
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 126032
SMILES:C12CCC(C)=CC1c1cc(CCCCC)cc(O)c1C(=O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.481
InChIKey:WCRLXWWOKLURMF-UHFFFAOYSA-N
ID: 126033
SMILES:C1(C)(C)Oc2c(c(O)cc(O)c2C(C)C)C2C1CC=C(CO)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -14.435
InChIKey:JQPBJCYZNHWCFY-UHFFFAOYSA-N
ID: 126034
SMILES:O1C(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)(C)O)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.195
InChIKey:OPPKSPIEDRRVTK-UHFFFAOYSA-N
ID: 126035
SMILES:CC1(C)Oc2c(c(O)cc(C)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 126036
SMILES:C(CCCc1cc(O)c2c(c1)OC1(C)CC(OC(C)=O)C(C(C)(C)O)CC1C2=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.728
InChIKey:HAXNLAWOWAWVHU-UHFFFAOYSA-N
ID: 126037
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 126038
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC1(C)CCCC2(C)C1C(=O)CC(C)C2C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.695
CB1 binding score: -16.244
InChIKey:BJIFSFQZLQWPSI-UHFFFAOYSA-N
ID: 126039
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 126040
SMILES:C(Cc1c(=O)c2c(cc(O)c1)OC(C)(C)C1C2C=C(C)CC1)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.971
InChIKey:YJTSNTMQDZUOAZ-UHFFFAOYSA-N
ID: 126041
SMILES:C(CC(=CCc1c(O)cc(CCCCC)cc1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 126042
SMILES:C1(C)(C)Oc2cc(C)cc(O)c2C(O)C2C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -13.466
InChIKey:WMCZIPQCMJIEQN-UHFFFAOYSA-N