ID: 7561
SMILES:Oc1cc(CCC)cc2c1-c1c(cc3c(c1)CCCC3=O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.431
CB1 binding score: -13.214
InChIKey:GELYWEVHLSQHGA-UHFFFAOYSA-N
ID: 7562
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 7563
SMILES:CC1(C)C2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.803
InChIKey:MDNHMTGEHDKVHY-UHFFFAOYSA-N
ID: 7564
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2cc(O)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -16.807
InChIKey:NKRLFRROTIRYCS-UHFFFAOYSA-N
ID: 7565
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.402
InChIKey:USZILQYXSONCHH-UHFFFAOYSA-N
ID: 7566
SMILES:C(O)(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.51
InChIKey:ONTMVGJDPXZQKB-UHFFFAOYSA-N
ID: 7567
SMILES:C(=O)(N)C(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.45
CB1 binding score: -12.246
InChIKey:VBDOAPZIBRZRQB-UHFFFAOYSA-N
ID: 7568
SMILES:C1CSCSc2c1cc(CCCCC)cc2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.447
CB1 binding score: -15.526
InChIKey:BPKVNXHOYJCUGC-UHFFFAOYSA-N
ID: 7569
SMILES:O=C(C1(CCCC)c2c(c3c(cc2)-c2cc(O)ccc2OC3(C)C)OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -17.542
InChIKey:BXCVMMHCJKWSJL-UHFFFAOYSA-N
ID: 7570
SMILES:c1c(C2C=C(C)CCC2C(=C)C)c(O)c(C=O)c(O)c1C(=O)C=CC=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.457
CB1 binding score: -14.582
InChIKey:IJZQGRMGYTZTNM-UHFFFAOYSA-N
ID: 7571
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 7572
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)cc(OC)c1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.438
InChIKey:RLMNRBUMROHRBN-UHFFFAOYSA-N
ID: 7573
SMILES:c12c(CCC(C(C)C)C)cc(C)cc1OC(C(O)C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.929
InChIKey:NFMCHHTUIFODSD-UHFFFAOYSA-N
ID: 7574
SMILES:CCCCOCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.56
InChIKey:CGUHTWMWKCPXQC-UHFFFAOYSA-N
ID: 7575
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -15.933
InChIKey:NATGMIDNOOVMAU-UHFFFAOYSA-N
ID: 7576
SMILES:NC(NCCC(c1cc(O)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)c1)O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.469
CB1 binding score: -13.196
InChIKey:QGGXQRIWSMIAES-UHFFFAOYSA-N
ID: 7577
SMILES:O=C1OC(c2c(O)cc(CCCCC)cc2O)C=C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 7578
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C=C(COC(C)=O)C=CC1C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.063
InChIKey:ZXHWQEMPXMBGBT-UHFFFAOYSA-N
ID: 7579
SMILES:C(=C(C)C)CCC(C)=CCOc1cc(C2=C(O)C(OC)=CC3=C2C2C(CCC2(O)C)C(C)(C)O3)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -15.874
InChIKey:IDNBWXGMIWRNLA-UHFFFAOYSA-N
ID: 7580
SMILES:C1(OC(=O)C)C2(C)CCC(C(C)C)C2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.679
InChIKey:OSVSYPBMXLJBEI-UHFFFAOYSA-N
ID: 7581
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N