ID: 139441
SMILES:C12C3C(c4c(O)cc(CCCCC)cc4OC1(C)C)CC(C)C3CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.522
InChIKey:STCFSGMSBAANPU-UHFFFAOYSA-N
ID: 139442
SMILES:c1c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 139443
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 139444
SMILES:O(C)c1cc(CCCCC)cc2c1C1C(=C(C)C)C(CC(C)C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.736
InChIKey:YJVDVDHTKJWHDN-UHFFFAOYSA-N
ID: 139445
SMILES:C12C(C(O)C(C)(O)CCC=C(CO)C)C(O)CC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.6
CB1 binding score: -11.2
InChIKey:LPYXDJSIHVZAMT-UHFFFAOYSA-N
ID: 139446
SMILES:c1(O)c(CC=C(CCC(=C(C)C)C)C)c(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.363
InChIKey:JYEWJVSCMCQDFG-UHFFFAOYSA-N
ID: 139447
SMILES:C1(C(C)C)CCC(CO)=CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.425
InChIKey:CUBYMHKAHNSHAM-UHFFFAOYSA-N
ID: 139448
SMILES:C1(C)=CCC(C(OC(=O)C)C(C)C)C(=O)C2=C1C(CC(C)C)C(c1c(O)cc(CCCCC)cc1O)(C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.752
CB1 binding score: -16.141
InChIKey:LEZGZNGYMZQRQA-UHFFFAOYSA-N
ID: 139449
SMILES:C1C(C)=CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.591
InChIKey:NXTGFCCTZAONCG-UHFFFAOYSA-N
ID: 139450
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc(C(OC(C)=O)C(C)=CC)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.322
InChIKey:PSEZJYIAEANPNT-UHFFFAOYSA-N
ID: 139451
SMILES:N(c1cccc(CCCC)c1)C(=O)C1C(CC=C(C)C)C(C)(C)C=CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.577
CB1 binding score: -16.502
InChIKey:VAHFJNRORLXUBY-UHFFFAOYSA-N
ID: 139452
SMILES:c1(O)cc(CC)c(O)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.569
InChIKey:NKQJFVVOMQBUDA-UHFFFAOYSA-N
ID: 139453
SMILES:c1(OC)cc(CCCCC)cc2c1C1CC(C(C)=C)CC3C21OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.428
InChIKey:UFVBINGFFBIJEP-UHFFFAOYSA-N
ID: 139454
SMILES:CC(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 139455
SMILES:Cc1c(-c2c(O)c(CC=C(C)CCC(C(O)(C)C)O)c(O)c(C(=O)CC(C)C)c2)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 634.854
CB1 binding score: -13.427
InChIKey:QMQRKSOYKYGWJP-UHFFFAOYSA-N
ID: 139456
SMILES:C12C(C(C)(C)Oc3ccc(O)c(C)c31)CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.767
InChIKey:PAEXFQCXJALBEH-UHFFFAOYSA-N
ID: 139457
SMILES:C(C(OC(C)=O)C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC)=O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.435
InChIKey:LOSHUGMMCMVLKT-UHFFFAOYSA-N
ID: 139458
SMILES:C(CCC)CCCCCCCCCC(=O)OC1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.829
CB1 binding score: -15.519
InChIKey:OHCHVKZAVDNVMH-UHFFFAOYSA-N
ID: 139459
SMILES:c1(O)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 139460
SMILES:c1(O)cc(C)c2c3c1C(C)(C)Oc1c(C(=O)C(C)C)c(O)c(O)c(C4C(C(C)=C)CC=C(C)C4)c1OC3(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.687
CB1 binding score: -16.822
InChIKey:PQLZHFKQTVZJCE-UHFFFAOYSA-N
ID: 139461
SMILES:c1c(Br)c(O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -18.662
InChIKey:OLWQGBDFFXCSTJ-UHFFFAOYSA-N