ID: 94900
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 94901
SMILES:C1=C(C)CCC2C(C)(O2)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.982
InChIKey:CKPQLRBRCDKZHC-UHFFFAOYSA-N
ID: 94902
SMILES:O1c2c(c(O)cc(CCCCCC)c2)-c2c3c(c1O)CC1C(=C)C(=O)OC1(C)CCC3C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: Not available
InChIKey:DNZRKIHTLLWBNR-UHFFFAOYSA-N
ID: 94903
SMILES:C(C=C(C)C)CC(C)=CCc1c(CCCc2cc(OC)c(O)c(CC=C(C)C)c2)cc(O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -13.703
InChIKey:ZXVSYEWVFAORGM-UHFFFAOYSA-N
ID: 94904
SMILES:CC1(C)C2C(O)CC(C)=CC2c2c(O)cc(CCCCOC(=O)C=CC=CC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.084
InChIKey:ZXFQOVVGCQIJTD-UHFFFAOYSA-N
ID: 94905
SMILES:C1(O)C2C(C)(CCCC(C)(C)OC3C(C)(C2C)Oc2cc(CCCCC)c(C(=O)O)c(O)c23)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.638
CB1 binding score: -12.518
InChIKey:LKMQLBBVDGIZEB-UHFFFAOYSA-N
ID: 94906
SMILES:C12C(C)(CCCC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.96
InChIKey:DDIVQORSYYKRDX-UHFFFAOYSA-N
ID: 94907
SMILES:OC12C(=C(c3c(O)c(C)c(OC)cc3)C(=O)C1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.691
InChIKey:DFXXJMZIOCSGCB-UHFFFAOYSA-N
ID: 94908
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 94909
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 94910
SMILES:CC1=CC2C(C)(C)Oc3cc(O)cc3c2C(=O)C(C)(C=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -17.179
InChIKey:XVCUDUAVOCVUBE-UHFFFAOYSA-N
ID: 94911
SMILES:C12(C)CCC(C(C)C)C(C=C3C(=O)CCC3)(O1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -13.188
InChIKey:KQJUVVFOQAVYKM-UHFFFAOYSA-N
ID: 94912
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC1(O)C(C)CCC1=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.391
InChIKey:GLPYQDCBCCBZSX-UHFFFAOYSA-N
ID: 94913
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 94914
SMILES:C1(CC=C(C)C)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.916
InChIKey:CDTXPOHIOLHGOM-UHFFFAOYSA-N
ID: 94915
SMILES:C(C=C(CCC=C(C)C)C)c1c(O)cc(CCCCC)c(C(=O)OC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 94916
SMILES:Oc1c2c(cc(O)c1CC=C(C)CCC=C(C)C)OC(C)(C)C1C2CC(C)=CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.941
InChIKey:NJHVTIVTQQYNDD-UHFFFAOYSA-N
ID: 94917
SMILES:C(C(=CCCC1=CCCC(C)=CCc2c(O)c(C)cc(O)c2)C1=O)CCC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.511
InChIKey:HSWQGGFAVOVLLE-UHFFFAOYSA-N
ID: 94918
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2(O)C1CC(=C)CCC1C(C)(CCC=C(C)CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -16.844
InChIKey:BPKDFPFMVYATEK-UHFFFAOYSA-N
ID: 94919
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(OC)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.703
InChIKey:ODGYRHKHFGCIRR-UHFFFAOYSA-N
ID: 94920
SMILES:C(CCCc1cc(O)c(CC=C(C)C)c(O)c1)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.06
InChIKey:DUNLYOQOJQUZRD-UHFFFAOYSA-N