ID: 94333
SMILES:c1(O)cc(CCCCC)c2c(c1)OC(C)(C)c1c-2cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.606
InChIKey:DFQAVTPEGZJBBU-UHFFFAOYSA-N
ID: 94334
SMILES:C(CC(C)(c1cc(OC2C(O)C(O)C(O)C(CO)O2)c2c(c1)C(O)C(O)C(C)(C)O2)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.504
CB1 binding score: -14.022
InChIKey:RHGDWKWVZBETHQ-UHFFFAOYSA-N
ID: 94335
SMILES:C(=C(C)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 94336
SMILES:O=Cc1c(O)c2c(cc1CCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.706
InChIKey:BRXQGSCNJVOECT-UHFFFAOYSA-N
ID: 94337
SMILES:CN(CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.608
CB1 binding score: -16.194
InChIKey:QHVKVERXMZLYDQ-UHFFFAOYSA-N
ID: 94338
SMILES:C(C)CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.288
InChIKey:VLEBLFTUFGSNIR-UHFFFAOYSA-N
ID: 94339
SMILES:c1(O)cc(CCCCC)cc(O)c1C1CC(C)C2CC(C2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.226
InChIKey:NFNCOYBTRVVNAP-UHFFFAOYSA-N
ID: 94340
SMILES:C12c3c(cc(CC=C(CCC=C(C)C)C)cc3O)OC(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.959
InChIKey:YONBVYJYQJTFMD-UHFFFAOYSA-N
ID: 94341
SMILES:c12cc(CCCCC)cc(OC)c1OC1OC(C)C=CC1(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.028
InChIKey:ZCDPURMJXFSRSA-UHFFFAOYSA-N
ID: 94342
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C(C(C)(C)O)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.015
InChIKey:IFIVAWPRNAPNJW-UHFFFAOYSA-N
ID: 94343
SMILES:OC12c3c(CCCCC)cc(O)c(CC=C(C)C)c3OC1(C)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.691
InChIKey:KJQBCEXBKIWARA-UHFFFAOYSA-N
ID: 94344
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.577
InChIKey:LHWLFYGKRIKNPZ-UHFFFAOYSA-N
ID: 94345
SMILES:C(C(C)C)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C=O)C=C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.037
InChIKey:UESDXMMIPIBACC-UHFFFAOYSA-N
ID: 94346
SMILES:OC(=O)c1c(CCCCC)cc2c(c1O)C1CC(C(C)C)C=CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.754
InChIKey:HSTRCOFJQGPBIT-UHFFFAOYSA-N
ID: 94347
SMILES:C1(O)C2C(C)(Oc3c(c(O)cc(CCCCCC)c3)C2)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.929
InChIKey:LYMCFKVYGDWNFH-UHFFFAOYSA-N
ID: 94348
SMILES:C1(C)CC2c3c(O)cc(CCCCC)cc3OC1(C(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.514
InChIKey:VBBLQHUWRPLIFY-UHFFFAOYSA-N
ID: 94349
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(=C)C1CC(O)C(=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.837
InChIKey:KYEYOJWBQQRSRT-UHFFFAOYSA-N
ID: 94350
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C(C)=C)C(O)CC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.018
InChIKey:KCVOPEXNYQARTN-UHFFFAOYSA-N
ID: 94351
SMILES:CC(C(c1c2c(ccc1O)C(=O)C1=C(C2=O)OC(C)(C)C2C1CC(C)=CC2)CCCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -15.04
InChIKey:MAEVTNROKBHYFT-UHFFFAOYSA-N
ID: 94352
SMILES:C1(C)(C)C2(C)C3CCC2(C(C)CC3Cc2cc(CCCO)cc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.438
InChIKey:OBQGWBJTFWBZPS-UHFFFAOYSA-N
ID: 94353
SMILES:C(CC(=CCc1c(O)cc(CCC)cc1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N