ID: 49687
SMILES:C(C1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.598
InChIKey:LLENDDNLPXXHPV-UHFFFAOYSA-N
ID: 49688
SMILES:C1(=O)C(C)C2C(C3(O)c4c(cc(CCCCC)cc4OC)OC3C(C(=C)C)=CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -16.129
InChIKey:RCKKXOVBSQFHII-UHFFFAOYSA-N
ID: 49689
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C2(C)C)OC(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.358
InChIKey:QLWKTYBYTKTSHG-UHFFFAOYSA-N
ID: 49690
SMILES:Oc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 49691
SMILES:c1c(C(CC)C)cc(O)c(C2C(C(C)=C)CCC(C)C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.732
InChIKey:KGVMZEQGRCCLJE-UHFFFAOYSA-N
ID: 49692
SMILES:c1(O)cc(CCc2cc(O)c3c(c2)OC(C)(C)C2CCC(C)C(C=CC(C)(C)O)OC3C2O)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.643
CB1 binding score: Not available
InChIKey:PJMLLVHPQNFNBW-UHFFFAOYSA-N
ID: 49693
SMILES:c1c(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)cc1CC=C(C)CC=CC(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.617
InChIKey:ZMCLPFZFVAMKKM-UHFFFAOYSA-N
ID: 49694
SMILES:C1(C)(C)Oc2cc(C(O)=O)cc(OC)c2C2C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.693
InChIKey:PFUVVIFIJXTHKN-UHFFFAOYSA-N
ID: 49695
SMILES:O(C1C(O)C(O)C(O)C(CO)O1)C(=O)C1(C(=O)OC)C=C2C(=O)c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 592.638
CB1 binding score: -14.759
InChIKey:XHKIFWWSEYOAOS-UHFFFAOYSA-N
ID: 49696
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)c(O)cc3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.493
InChIKey:ITYHJPGRQYSNFQ-UHFFFAOYSA-N
ID: 49697
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(C(C)(C(O)C(CCCCCC)C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.929
InChIKey:MUHCEZPGFPNDDF-UHFFFAOYSA-N
ID: 49698
SMILES:C(C(=C1Cc2c(O)cc(CCCCC)cc2O1)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.552
InChIKey:SUYGWNSKJRATHG-UHFFFAOYSA-N
ID: 49699
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.574
InChIKey:YXTLUVOQFZQLMQ-UHFFFAOYSA-N
ID: 49700
SMILES:C12(CC1)C(C)(C)Oc1c(cc(O)c(C(O)c3cc4c(c(CC5C(CO)CCC5C(=C)C)c3O)C4)c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.612
CB1 binding score: -15.282
InChIKey:BEPWFVOGDQIAPP-UHFFFAOYSA-N
ID: 49701
SMILES:C12(C)Oc3c(c(O)cc(CCCCCC)c3)C3OC(C)(C)C2CCC(C)C3CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.17
InChIKey:KYPYUBNRZAKMMG-UHFFFAOYSA-N
ID: 49702
SMILES:C12C(C(OC)=O)(c3c(cc(CCCCC)cc3O)O1)CC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.483
InChIKey:YEVYRBMCGLMUNX-UHFFFAOYSA-N
ID: 49703
SMILES:C(c1cc(O)c2c3c1OC(C)(C)C1C2CC(C)(OC1)C3)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.975
InChIKey:HEAUZSLCQLMNCS-UHFFFAOYSA-N
ID: 49704
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(OC)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 49705
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(COC(=O)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 49706
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C3(O)C2(C)C(C)(C(C)C3)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.239
InChIKey:TUHRPFHBCHSPJC-UHFFFAOYSA-N
ID: 49707
SMILES:C12C=C(C)C(O)CC1C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.502
InChIKey:UNFJXZQMMUBFHX-UHFFFAOYSA-N