ID: 57121
SMILES:CC1=CC2c3c(O)cc(CCCCC)c(C=O)c3OC2(C)CCC1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -17.063
InChIKey:NRDZBTKCGYGQNE-UHFFFAOYSA-N
ID: 57122
SMILES:CC1=CCCC(C=O)=CCC2c3c(cc(CCCCC)c(C(=O)OC)c3O)OC2(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.627
InChIKey:DCLDDJPAPKMWIQ-UHFFFAOYSA-N
ID: 57123
SMILES:C1(C)CC(c2c(O)cc(CCCCC)cc2O)C2C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.823
InChIKey:YFLNIZMCUWLWIV-UHFFFAOYSA-N
ID: 57124
SMILES:CC1=CCC2C(C1)c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 57125
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.781
InChIKey:CTZSPTCATADZMP-UHFFFAOYSA-N
ID: 57126
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC3(C(O)(C)CCC3C(C)=C)C2C1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.776
CB1 binding score: -15.53
InChIKey:PODLENLZGVCYHJ-UHFFFAOYSA-N
ID: 57127
SMILES:C(C1(C)C(O)CCC2(C)C3(C(C)CC(=O)C21)Cc1c(O)cc(CCCCC)cc1O3)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -15.016
InChIKey:RBBGBYISVHHKAG-UHFFFAOYSA-N
ID: 57128
SMILES:C12(O)C(CC=C(C)C1O)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -15.983
InChIKey:XOMOFDIPGFCUEA-UHFFFAOYSA-N
ID: 57129
SMILES:C12C(C)(CCCC1(O)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.795
InChIKey:JROOGDDXVVHMKF-UHFFFAOYSA-N
ID: 57130
SMILES:c1c(CCCC)c(C)c(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.893
InChIKey:FOZAROQCYZEEME-UHFFFAOYSA-N
ID: 57131
SMILES:Oc1c(C(=O)OC)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.109
InChIKey:HCVQNFRSSBTPDB-UHFFFAOYSA-N
ID: 57132
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 57133
SMILES:c12c(c(CCC)ccc1C1(C)OC(C)(C)CCC1)cc(CCCCC)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.177
InChIKey:CFKLMRFPYSHGCF-UHFFFAOYSA-N
ID: 57134
SMILES:C12C(CC(=O)C(C)(O)C1=O)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -16.423
InChIKey:LQQARFFCXPJMCW-UHFFFAOYSA-N
ID: 57135
SMILES:C1C(OC2OC(CO)C(O)C(O)C2O)CC2(C(C)(C)CCC(=O)C2C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.662
CB1 binding score: -15.685
InChIKey:DSCFBQTULAILPX-UHFFFAOYSA-N
ID: 57136
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C(C)(C)O)OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.8
InChIKey:UYVKHMMSCOFQHL-UHFFFAOYSA-N
ID: 57137
SMILES:c1(=O)c2c(oc3c1c(CCCCC)cc(O)c3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -16.363
InChIKey:CSOBOOADWNRORJ-UHFFFAOYSA-N
ID: 57138
SMILES:C(C)CCc1cc2c(cc1O)OC(C)(C)C1CCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.39
InChIKey:NGPLMWBCUULHHO-UHFFFAOYSA-N
ID: 57139
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC3C(C)(C)CCCC3(C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.078
InChIKey:YDDUPJSOQLVTAX-UHFFFAOYSA-N
ID: 57140
SMILES:CC1=CCC(C2=CC(CCC3(C)C(C)Oc4c3c(O)cc(CCCCC)c4)OC2)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -14.233
InChIKey:CMJPAJIMYQFQJW-UHFFFAOYSA-N
ID: 57141
SMILES:C(C)(C)=CCCC(=CCCC(C)=CCc1c(O)cc(CCCCCO)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -16.782
InChIKey:ZKKSUUGHFOIVDB-UHFFFAOYSA-N