ID: 88642
SMILES:CC1(C)C(CO)OC2(c3c(c(C)cc(O)c3)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -15.891
InChIKey:HWQREVYAWDEBJY-UHFFFAOYSA-N
ID: 88643
SMILES:c1(O)cc(CCCCC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.133
InChIKey:NWNXONBQZMRACD-UHFFFAOYSA-N
ID: 88644
SMILES:C12(CC1)Oc1c(c(O)c(C(=O)O)c(CCCCC)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -14.007
InChIKey:OKELQXCCZMZAJB-UHFFFAOYSA-N
ID: 88645
SMILES:c1(=O)c(Cl)c(O)cc(OC)c2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.815
CB1 binding score: -16.888
InChIKey:UERIOHKFRJUPLV-UHFFFAOYSA-N
ID: 88646
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC1=C(C)CC(O)CC1(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.403
InChIKey:IDKMCZZRWXKXOR-UHFFFAOYSA-N
ID: 88647
SMILES:CC12CC3c4c(O)cc(CCCCC)cc4OC3(C)CCC1OC(C1(C)OC1)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.909
InChIKey:QAGOIJACGTXDEP-UHFFFAOYSA-N
ID: 88648
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.392
InChIKey:RCCCKQKOMSTGQP-UHFFFAOYSA-N
ID: 88649
SMILES:CC(C(Cc1c2c(c(O)c(C)c1CCCCC)OC(C)(C)C1CCC(C)(O)C12)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -12.071
InChIKey:NBEANVHSSCIRID-UHFFFAOYSA-N
ID: 88650
SMILES:C12(C)CCC(C(C)C)C3CC1C(C)(Oc1c2c(OC)cc(CCCCCC)c1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -18.33
InChIKey:ZTOHQBVAJLBWNY-UHFFFAOYSA-N
ID: 88651
SMILES:CC1(C)Oc2c(c(O)cc(C)c2)C2C=C(C(C)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.395
InChIKey:YTRDNZSKIOUQRQ-UHFFFAOYSA-N
ID: 88652
SMILES:C=CC(C(c1c(O)c(C2C=C(CCC=C(C)C)CCC2C)c(O)c(CC=C(C)C)c1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -13.521
InChIKey:DCPDAMIGLDZKKB-UHFFFAOYSA-N
ID: 88653
SMILES:CC1(C)CC(=O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C12O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.883
InChIKey:JLVCDZGFQJJMOU-UHFFFAOYSA-N
ID: 88654
SMILES:C1(CO)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 88655
SMILES:O1C(C)(C)C2CCC(C)=CC2C(CCCC)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.41
CB1 binding score: -14.171
InChIKey:HFYLCHNYLDPZHB-UHFFFAOYSA-N
ID: 88656
SMILES:C1CC2(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.182
InChIKey:RLZGZZJZSCGQPJ-UHFFFAOYSA-N
ID: 88657
SMILES:Oc1c(C)c(I)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.257
CB1 binding score: -15.644
InChIKey:YLPHISARZZAACS-UHFFFAOYSA-N
ID: 88658
SMILES:CCCCC=Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.774
InChIKey:OAXUHIYWRRFWIX-UHFFFAOYSA-N
ID: 88659
SMILES:C(CC(CO)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.913
InChIKey:KJXUGWAEJOKAEH-UHFFFAOYSA-N
ID: 88660
SMILES:O1C2CCC(C)(O)C3=C2C1C(C)(C)Oc1c3c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.522
InChIKey:AQHZMLLVHOWEFX-UHFFFAOYSA-N
ID: 88661
SMILES:C(c1cc(-c2c3c(c(OCC)cc2OC)C2C(C(C)(C)O3)CCC(C)=C2)ccc1)CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.631
CB1 binding score: -16.615
InChIKey:PXVUQHBYCBUTJZ-UHFFFAOYSA-N
ID: 88662
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N