ID: 96580
SMILES:c1(O)cc(O)c2c(c1C(CC(O)C(O)C)O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -15.133
InChIKey:BXXWJECYVMFNDJ-UHFFFAOYSA-N
ID: 96581
SMILES:C(C)CCc1cc(O)c(C2C(C(C)=C)CC(Cl)C(C)(O)C2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.902
CB1 binding score: -14.214
InChIKey:QLOAVMKQAXKFHF-UHFFFAOYSA-N
ID: 96582
SMILES:Oc1cc(CCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 96583
SMILES:C(CC)=CCc1c(C)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.644
InChIKey:NCNVMQSCYLVAGW-UHFFFAOYSA-N
ID: 96584
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 96585
SMILES:c12c(c(Br)c(CCCCC)cc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.365
CB1 binding score: -17.496
InChIKey:POSCTVHGATWSJR-UHFFFAOYSA-N
ID: 96586
SMILES:c1(CCCCC)cc2c(c(O)c1CC(C(C)=C)OC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.502
InChIKey:CPFWDNKQLLLTDL-UHFFFAOYSA-N
ID: 96587
SMILES:O1C(O)C2CCC3C2(C)C1c1c(O)cc(CCCCC)cc1O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.641
InChIKey:GDWLGNSPUVOITN-UHFFFAOYSA-N
ID: 96588
SMILES:CC1(CCCc2ccc(O)cc2)Oc2c(c(O)cc(CCC)c2)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.041
InChIKey:LONHDDASFHGHJZ-UHFFFAOYSA-N
ID: 96589
SMILES:C(C)CCCc1cc(O)c2c(c1)C1C(C(C)(CCC=C(C)CCC=C(C)C)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.676
InChIKey:QQHLZHXCCOBBRH-UHFFFAOYSA-N
ID: 96590
SMILES:C(Cc1cc(C2C=C(C)CCC2C(C)C)c(O)c(CC=C(C)CCC=C(C)C)c1O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.502
InChIKey:BDMONVKEFZODBV-UHFFFAOYSA-N
ID: 96591
SMILES:C(C)CCCc1cc(O)c(C2C(C(C)=C)CC(=O)C(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 96592
SMILES:C1=C2c3c(cc(CCCCC)cc3OC2(C)C)C(=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.562
InChIKey:JIQNJEQHNLVAPA-UHFFFAOYSA-N
ID: 96593
SMILES:C1(O)c2c(O)c(C(=O)C)c(CCC)cc2OC1(C)CCC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.395
InChIKey:AOXOZFBSZOPUBK-UHFFFAOYSA-N
ID: 96594
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCCCC)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.677
InChIKey:YWEZXUNAYVCODW-UHFFFAOYSA-N
ID: 96595
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.233
InChIKey:LXSFNMQURHTPIT-UHFFFAOYSA-N
ID: 96596
SMILES:CC1(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 96597
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96598
SMILES:C1(=O)C2(Oc3c1c(OC)cc(CCCCCC)c3)C1C(CCC(C)=CCCC(C)=C2)OC(=O)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -15.306
InChIKey:SSVFXQAMTWHVFP-UHFFFAOYSA-N
ID: 96599
SMILES:c1c(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 96600
SMILES:C1C(C)=CCC(C)(C(C)=C)Oc2cc(C)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -14.477
InChIKey:VLICWOCCLPLTJY-UHFFFAOYSA-N