ID: 98470
SMILES:OC(C(CO)C)c1cc(O)c2c(c1)OC1(C)CCC3C(C)(C)C3C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.87
InChIKey:LVLHIKBKPBPSOJ-UHFFFAOYSA-N
ID: 98471
SMILES:C1CC(C(C)C)C(c2c(O)cc(CC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.748
InChIKey:LLAAZDYTZYGRPH-UHFFFAOYSA-N
ID: 98472
SMILES:O(C)C(c1c(CCCCC)cc(O)c2c1OC1(C)C(C(C)(C)CC(C=C(C)C)C1)C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -16.002
InChIKey:KRQWUXOYILXJRI-UHFFFAOYSA-N
ID: 98473
SMILES:C(CC(=CCc1c(O)cc(CCC)cc1O)C)CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -18.088
InChIKey:OEGUJXLLNWKNBN-UHFFFAOYSA-N
ID: 98474
SMILES:C1(Br)CCC(C)(O)C(CCC(CCCC(C)(CCCC2=CCc3cc(O)cc(C)c3O2)C)OC(C)=O)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 595.615
CB1 binding score: -14.463
InChIKey:REYOCDWHLXMHSE-UHFFFAOYSA-N
ID: 98475
SMILES:O(C(c1ccc2c(c1CC)OC(C)(C)C1CCC(C)=CC21)=O)Cc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -16.799
InChIKey:DCPABEPLVBAIRA-UHFFFAOYSA-N
ID: 98476
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 98477
SMILES:C1C=C(C)CCC(O)C(C)=CC(c2c(O)cc(C)cc2O)C(C)(C)C2CCC(C)=C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.929
InChIKey:PAKYLQVEIOQMFR-UHFFFAOYSA-N
ID: 98478
SMILES:C1(C)=CC2C(C1)C(C)(C)Oc1c(O)c(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.982
InChIKey:MKQZKPGOXSRMPB-UHFFFAOYSA-N
ID: 98479
SMILES:c1(-c2cc(O)c3c(c2)OC(C)(C)C2C3C=C(C)CC2)cc(O)c(CC(CC=C(C)C)C(C)=C)cc1-c1occ(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.755
CB1 binding score: -15.237
InChIKey:CBFKFEKKWHEDMM-UHFFFAOYSA-N
ID: 98480
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1C2(C)C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.606
InChIKey:DNHDGOKDEDXJBM-UHFFFAOYSA-N
ID: 98481
SMILES:C(=O)(OC)c1cc2c3c(cc(CCCCC)c2)OC(C)(C)C(CCC(O)(C)C1)OC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.929
InChIKey:MCLPVKAHKGKISQ-UHFFFAOYSA-N
ID: 98482
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)ccc3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 98483
SMILES:CCCCc1cc2c(c(O)c1)C1C(C3C(=C1)C1(C)CCC(=O)C(C)(C)OC1CC3)cco2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -15.196
InChIKey:RHFKXTVYOZNRNZ-UHFFFAOYSA-N
ID: 98484
SMILES:C1(C)=CCC(C(=CCc2c(O)c(C)cc(OC)c2)C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.502
InChIKey:LZPWFMMUISSNAG-UHFFFAOYSA-N
ID: 98485
SMILES:C(C=C(C)C)CC(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 98486
SMILES:C1(CCCCCCO)Oc2c(cccc2C(=O)OC)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.258
InChIKey:XDNBNTDPZHGTGX-UHFFFAOYSA-N
ID: 98487
SMILES:C1C(Cl)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C(C(O)=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.885
CB1 binding score: -15.418
InChIKey:IQNVBAADGXGDQU-UHFFFAOYSA-N
ID: 98488
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 98489
SMILES:C(C=C(C)CCC1C(C)(C)O1)CC1(C)C=Cc2cc(O)ccc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.509
InChIKey:XTVFMVOKSWJIQO-UHFFFAOYSA-N
ID: 98490
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.237
InChIKey:RPVCVRVOIMLNEQ-UHFFFAOYSA-N